Home Other Building Blocks 4-(furan-2-yl)-5-methylpyrrolidin-2-one

4-(furan-2-yl)-5-methylpyrrolidin-2-one

CAS No.:
1477718-83-4
Catalog Number:
AG01C0IE
Molecular Formula:
C9H11NO2
Molecular Weight:
165.1891
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Product Description
Catalog Number:
AG01C0IE
Chemical Name:
4-(furan-2-yl)-5-methylpyrrolidin-2-one
CAS Number:
1477718-83-4
Molecular Formula:
C9H11NO2
Molecular Weight:
165.1891
MDL Number:
MFCD21691716
IUPAC Name:
4-(furan-2-yl)-5-methylpyrrolidin-2-one
InChI:
InChI=1S/C9H11NO2/c1-6-7(5-9(11)10-6)8-3-2-4-12-8/h2-4,6-7H,5H2,1H3,(H,10,11)
InChI Key:
GKTYXTCYDJXAAS-UHFFFAOYSA-N
SMILES:
O=C1NC(C(C1)c1ccco1)C
Properties
Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.079g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
165.192g/mol
Monoisotopic Mass:
165.079g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties